ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate
TL;DR: ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate (CAS 478063-91-1) is a chemical compound with molecular formula C18H24FNO3 and molecular weight 321.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[(2-fluorophenyl)-(2-oxocyclooctyl)methyl]carbamate
Also Known As: ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate, ethyl N-[(2-fluorophenyl)-(2-oxocyclooctyl)methyl]carbamate, 6R-0036, Ethyl N-(2-fluorophenyl)(2-oxocyclooctyl)methylcarbamate, ethylN-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate
| Molecular Formula | C18H24FNO3 |
|---|---|
| Molecular Weight | 321.17 g/mol |
| LogP | 4.1524 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.174 |
| Heavy Atoms | 23 |
| Complexity | 546.8232 |
Chemical Identifiers
| CAS Number | 478063-91-1 |
|---|---|
| SMILES | CCOC(=O)NC(C1CCCCCCC1=O)C2=CC=CC=C2F |
Product Overview
ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate (CAS 478063-91-1), with molecular formula C18H24FNO3 and molecular weight 321.17 g/mol. IUPAC: ethyl N-[(2-fluorophenyl)-(2-oxocyclooctyl)methyl]carbamate.
Chemical Property Profile of ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate
Property Insights of ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate
The XLogP value of 4.1524 indicates that ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate?
The CAS number of ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate is 478063-91-1.
What is the molecular formula of ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate?
The molecular formula of ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate is C18H24FNO3.
What is the molecular weight of ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate?
The molecular weight of ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate is 321.17 g/mol.
Where can I buy ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate?
You can request a quote for ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[(2-fluorophenyl)(2-oxocyclooctyl)methyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.